General Information of the Compound
| Compound ID |
CP0852573
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| Compound Name |
4-(3,3-dimethylpyrrolidin-1-yl)-1-(2-(piperidin-1-yl)ethyl)-1H-pyrazolo[3,4-d]pyrimidine
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| Structure |
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| Formula |
C18H28N6
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| Molecular Weight |
328.464
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| Canonical SMILES |
CC1(C)CCN(c2ncnc3c2cnn3CCN2CCCCC2)C1
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| InChI |
InChI=1S/C18H28N6/c1-18(2)6-9-23(13-18)16-15-12-21-24(17(15)20-14-19-16)11-10-22-7-4-3-5-8-22/h12,14H,3-11,13H2,1-2H3
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| InChIKey |
KNVMKWMIXDJQAN-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound